N-butyl-4,6-dimethoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine

C18H33N5O2 — CID 21293829

IUPACN-butyl-4,6-dimethoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine
SMILESCCCCN(c1nc(OC)nc(OC)n1)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C18H33N5O2/c1-8-9-10-23(13-11-17(2,3)22-18(4,5)12-13)14-19-15(24-6)21-16(20-14)25-7/h13,22H,8-12H2,1-7H3
InChIKeyPNFMRKGIKCIBET-UHFFFAOYSA-N
MW351.50 g/mol
LogP2.80
Rot. Bonds7

About N-butyl-4,6-dimethoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine

N-butyl-4,6-dimethoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine (PubChem CID 21293829) has the molecular formula C18H33N5O2 and a molecular weight of 351.50 g/mol. Its IUPAC name is N-butyl-4,6-dimethoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-butyl-4,6-dimethoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine
PubChem CID21293829
Molecular FormulaC18H33N5O2
Molecular Weight351.50 g/mol
Exact Mass351.26
IUPAC NameN-butyl-4,6-dimethoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine
SMILESCCCCN(c1nc(OC)nc(OC)n1)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C18H33N5O2/c1-8-9-10-23(13-11-17(2,3)22-18(4,5)12-13)14-19-15(24-6)21-16(20-14)25-7/h13,22H,8-12H2,1-7H3
InChIKeyPNFMRKGIKCIBET-UHFFFAOYSA-N
XLogP2.80
TPSA72.40 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.50
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-butyl-4,6-dimethoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine?
The IUPAC name of N-butyl-4,6-dimethoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine (CID 21293829) is N-butyl-4,6-dimethoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine.
What is the SMILES notation for N-butyl-4,6-dimethoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine?
The canonical SMILES for N-butyl-4,6-dimethoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine is CCCCN(c1nc(OC)nc(OC)n1)C1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of N-butyl-4,6-dimethoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine?
The InChIKey is PNFMRKGIKCIBET-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H33N5O2/c1-8-9-10-23(13-11-17(2,3)22-18(4,5)12-13)14-19-15(24-6)21-16(20-14)25-7/h13,22H,8-12H2,1-7H3.
What are the key properties of N-butyl-4,6-dimethoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine?
N-butyl-4,6-dimethoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine has a molecular weight of 351.50 g/mol, XLogP of 2.80, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-4,6-dimethoxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 21293829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).